#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mgs n SER 2 N 0.00 -1.11 -4.64 0.00 3.41 -1.26 -5.14 113.62 104.88 1mgs n SER 2 Ca 0.00 -1.67 -0.35 0.00 -0.26 0.00 0.00 58.87 56.59 1mgs n SER 2 Cb 0.00 1.07 -0.10 0.00 -0.26 0.00 0.00 64.21 64.92 1mgs n SER 2 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1mgs s VAL 3 N 0.02 4.41 0.00 -3.33 0.11 -1.26 -4.98 120.40 115.38 1mgs s VAL 3 Ca 0.16 -0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.02 1mgs s VAL 3 Cb 0.24 -2.91 0.00 0.00 -1.53 0.00 0.00 36.38 32.18 1mgs s VAL 3 CO -0.17 0.54 0.00 0.00 -3.33 0.00 0.00 175.10 172.14 1mgs n ALA 4 N 2.84 0.00 -3.51 1.54 0.00 -1.26 -4.92 120.51 115.21 1mgs n ALA 4 Ca -0.18 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.26 1mgs n ALA 4 Cb 0.53 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 1mgs n ALA 4 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1mgs s THR 5 N 0.00 -0.30 0.00 0.00 2.01 -1.26 -5.17 115.64 110.92 1mgs s THR 5 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1mgs s THR 5 Cb 0.00 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1mgs s THR 5 CO 0.00 0.00 0.00 1.21 -0.69 0.00 0.00 174.62 175.14 1mgs n GLU 6 N 4.44 3.38 -3.65 4.92 2.13 -1.26 -5.16 120.64 125.45 1mgs n GLU 6 Ca -0.13 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.66 1mgs n GLU 6 Cb 0.55 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.21 1mgs n GLU 6 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1mgs s LEU 7 N 0.00 -1.06 0.11 4.31 1.43 -1.26 -5.16 118.68 117.05 1mgs s LEU 7 Ca 0.00 1.49 0.03 0.00 -1.03 0.00 0.00 54.13 54.62 1mgs s LEU 7 Cb 0.00 2.18 -0.04 0.00 0.03 0.00 0.00 46.19 48.36 1mgs s LEU 7 CO 0.00 -0.22 -0.08 -0.13 0.23 0.00 0.00 176.35 176.14 1mgs s ARG 8 N 2.75 0.91 -0.83 1.70 1.81 -1.26 -4.45 118.95 119.57 1mgs s ARG 8 Ca -0.06 -1.34 -0.31 0.00 -1.72 0.00 0.00 55.73 52.30 1mgs s ARG 8 Cb -0.11 -0.40 -0.18 0.00 -0.45 0.00 0.00 34.95 33.81 1mgs s ARG 8 CO -0.18 0.03 2.58 0.00 -0.68 0.00 0.00 175.30 177.04 1mgs n GLN 10 N 8.51 0.00 -3.20 0.00 1.13 -1.26 -3.26 117.38 119.30 1mgs n GLN 10 Ca 0.58 0.44 -0.23 0.00 -1.94 0.00 0.00 57.00 55.85 1mgs n GLN 10 Cb 0.14 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 28.93 1mgs n GLN 10 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1mgs h LEU 12 N 3.80 -0.16 -8.07 0.00 3.38 -1.95 -3.32 115.31 108.99 1mgs h LEU 12 Ca 0.08 0.21 -0.67 0.00 0.09 0.00 0.00 57.88 57.59 1mgs h LEU 12 Cb 0.88 0.32 -0.34 0.00 0.09 0.00 0.00 40.66 41.61 1mgs h LEU 12 CO 0.49 -0.19 -0.81 -1.58 0.09 0.00 0.00 178.44 176.44 1mgs s GLN 13 N -5.99 2.84 0.63 1.13 -0.44 -1.26 -5.11 119.66 111.45 1mgs s GLN 13 Ca -0.13 -0.95 -0.02 0.00 -2.50 0.00 0.00 55.36 51.77 1mgs s GLN 13 Cb 0.25 -2.77 0.06 0.00 -1.64 0.00 0.00 33.01 28.91 1mgs s GLN 13 CO 0.77 -0.32 0.89 0.95 0.50 0.00 0.00 175.29 178.07 1mgs s THR 14 N 1.28 2.46 0.03 -0.34 -4.23 -1.25 -4.82 115.64 108.77 1mgs s THR 14 Ca 0.01 -0.51 0.09 0.00 -1.18 0.00 0.00 61.69 60.10 1mgs s THR 14 Cb -0.15 -2.94 -0.03 0.00 1.34 0.00 0.00 72.50 70.71 1mgs s THR 14 CO -0.09 0.00 -0.26 -0.76 -0.54 0.00 0.00 174.62 172.97 1mgs s LEU 15 N -4.99 2.17 0.38 4.79 1.43 0.34 -4.84 118.68 117.95 1mgs s LEU 15 Ca 0.60 -0.56 0.20 0.00 -1.03 0.00 0.00 54.13 53.33 1mgs s LEU 15 Cb -0.10 -1.31 1.19 0.00 0.03 0.00 0.00 46.19 46.01 1mgs s LEU 15 CO 0.41 0.27 1.67 -0.61 0.23 0.00 0.00 176.35 178.32 1mgs h GLN 16 N 4.89 0.26 0.00 1.70 4.15 -1.93 -2.59 115.11 121.59 1mgs h GLN 16 Ca -0.46 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 58.94 1mgs h GLN 16 Cb 1.14 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.77 1mgs h GLN 16 CO 0.44 0.17 0.00 0.41 -1.93 0.00 0.00 178.83 177.92 1mgs n GLY 17 N -1.38 4.41 3.33 2.39 0.00 -1.26 -3.99 105.19 108.68 1mgs n GLY 17 Ca 0.32 -1.45 -0.21 0.00 0.00 0.00 0.00 46.02 44.69 1mgs n GLY 17 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1mgs s ILE 18 N -2.06 1.75 0.71 -0.61 -0.00 -1.26 -5.03 121.20 114.71 1mgs s ILE 18 Ca 0.00 -1.96 -0.17 0.00 -0.00 0.00 0.00 60.65 58.52 1mgs s ILE 18 Cb 0.00 -1.85 -0.12 0.00 -0.00 0.00 0.00 42.46 40.49 1mgs s ILE 18 CO 0.00 -0.38 -0.16 1.57 -0.00 0.00 0.00 174.94 175.97 1mgs n HIS 19 N 0.18 -3.04 1.22 1.37 -0.00 -1.26 -4.78 115.22 108.90 1mgs n HIS 19 Ca -0.12 0.28 0.12 0.00 0.46 0.00 0.00 57.72 58.46 1mgs n HIS 19 Cb 0.58 -1.67 0.64 0.00 -0.12 0.00 0.00 29.99 29.41 1mgs n HIS 19 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1mgs n PRO 20 N 1.20 0.40 0.17 1.57 -0.04 -1.26 -2.57 135.00 134.47 1mgs n PRO 20 Ca 0.06 0.05 0.08 0.00 -0.04 0.00 0.00 63.50 63.64 1mgs n PRO 20 Cb 0.50 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.54 1mgs n PRO 20 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1mgs h LYS 21 N 0.00 0.00 -2.31 0.54 5.09 -2.02 -3.32 116.57 114.55 1mgs h LYS 21 Ca 0.00 0.00 -0.80 0.00 0.09 0.00 0.00 60.65 59.94 1mgs h LYS 21 Cb 0.20 0.00 -0.25 0.00 0.10 0.00 0.00 32.23 32.29 1mgs h LYS 21 CO 0.00 0.21 1.24 0.09 -2.09 0.00 0.00 179.45 178.90 1mgs n ASN 22 N -3.09 7.47 -4.09 7.07 3.02 -1.06 -4.75 115.26 119.83 1mgs n ASN 22 Ca 0.02 -3.61 -0.10 0.00 -0.03 0.00 0.00 54.58 50.86 1mgs n ASN 22 Cb 0.63 -1.20 -0.08 0.00 -0.61 0.00 0.00 39.78 38.52 1mgs n ASN 22 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1mgs s ILE 23 N -3.87 0.04 0.00 2.41 -1.09 -1.25 -4.28 121.20 113.16 1mgs s ILE 23 Ca 0.41 -1.73 0.00 0.00 -2.23 0.00 0.00 60.65 57.11 1mgs s ILE 23 Cb 0.19 -2.16 0.00 0.00 -1.58 0.00 0.00 42.46 38.91 1mgs s ILE 23 CO -0.12 -0.20 0.00 0.00 -1.23 0.00 0.00 174.94 173.38 1mgs n GLN 24 N -0.23 0.00 -4.41 2.79 -0.00 0.43 -2.82 117.38 113.14 1mgs n GLN 24 Ca -0.03 0.00 -0.22 0.00 -0.00 0.00 0.00 57.00 56.75 1mgs n GLN 24 Cb 0.64 0.00 -0.09 0.00 -0.00 0.00 0.00 30.24 30.79 1mgs n GLN 24 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1mgs s SER 25 N -1.00 2.17 -0.36 2.61 1.04 -0.88 -4.88 113.70 112.41 1mgs s SER 25 Ca 0.00 -1.64 0.04 0.00 0.48 0.00 0.00 55.95 54.83 1mgs s SER 25 Cb 0.00 0.45 0.16 0.00 0.10 0.00 0.00 66.02 66.73 1mgs s SER 25 CO 0.00 -0.93 0.44 -0.69 0.98 0.00 0.00 173.24 173.04 1mgs s VAL 26 N -3.38 -0.53 -0.42 5.02 1.01 -1.26 -2.28 120.40 118.56 1mgs s VAL 26 Ca 0.31 -0.65 -0.19 0.00 0.00 0.00 0.00 61.98 61.45 1mgs s VAL 26 Cb 0.04 -0.59 0.02 0.00 0.00 0.00 0.00 36.38 35.84 1mgs s VAL 26 CO 0.18 -0.41 0.54 0.21 0.00 0.00 0.00 175.10 175.62 1mgs s ASN 27 N 1.73 6.27 -0.33 3.32 3.84 0.42 -4.88 114.94 125.30 1mgs s ASN 27 Ca 0.15 -0.44 0.03 0.00 0.21 0.00 0.00 52.86 52.82 1mgs s ASN 27 Cb -0.12 -2.27 0.10 0.00 -0.55 0.00 0.00 41.25 38.40 1mgs s ASN 27 CO -0.09 -0.66 0.05 -0.69 -2.79 0.00 0.00 177.10 172.92 1mgs s VAL 28 N 2.49 2.07 -0.46 -5.21 1.01 -1.26 0.97 120.40 120.01 1mgs s VAL 28 Ca 0.18 -2.20 -0.17 0.00 0.00 0.00 0.00 61.98 59.79 1mgs s VAL 28 Cb -0.15 -2.53 0.05 0.00 0.00 0.00 0.00 36.38 33.75 1mgs s VAL 28 CO 0.16 -0.60 0.45 -1.59 0.00 0.00 0.00 175.10 173.51 1mgs s LYS 29 N 1.01 3.03 1.05 2.72 -2.85 -0.44 -4.96 119.74 119.29 1mgs s LYS 29 Ca 0.11 -1.10 -0.23 0.00 -1.00 0.00 0.00 55.97 53.75 1mgs s LYS 29 Cb -0.19 -4.08 -0.04 0.00 -2.06 0.00 0.00 37.83 31.46 1mgs s LYS 29 CO -0.10 -1.01 -0.75 -1.13 0.10 0.00 0.00 175.35 172.45 1mgs n SER 30 N 5.49 -2.69 -4.72 0.03 3.41 -1.26 -2.57 113.62 111.31 1mgs n SER 30 Ca -0.10 -0.08 -0.42 0.00 -0.26 0.00 0.00 58.87 58.02 1mgs n SER 30 Cb 0.45 -0.71 -0.04 0.00 -0.26 0.00 0.00 64.21 63.65 1mgs n SER 30 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1mgs s PRO 31 N -2.71 4.57 0.00 4.33 0.04 -1.26 -4.59 135.00 135.39 1mgs s PRO 31 Ca 0.44 1.56 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1mgs s PRO 31 Cb -0.00 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1mgs s PRO 31 CO 0.63 -0.00 0.00 0.41 0.04 0.00 0.00 177.00 178.08 1mgs n GLY 32 N 2.64 5.51 0.00 0.56 0.00 -0.88 -4.87 105.19 108.15 1mgs n GLY 32 Ca 0.05 -0.91 0.03 0.00 0.00 0.00 0.00 46.02 45.18 1mgs n GLY 32 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mgs n PRO 33 N 0.00 0.86 0.00 1.61 -0.04 -1.26 -3.12 135.00 133.05 1mgs n PRO 33 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1mgs n PRO 33 Cb 0.00 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 1mgs n PRO 33 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1mgs n HIS 34 N -0.59 0.00 -3.17 0.54 1.44 -1.26 -4.98 115.22 107.20 1mgs n HIS 34 Ca 0.04 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.78 1mgs n HIS 34 Cb 0.02 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.12 1mgs n HIS 34 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1mgs h ALA 36 N 7.65 2.36 -2.70 0.00 0.00 -1.90 -2.33 119.26 122.33 1mgs h ALA 36 Ca 0.01 -0.02 -0.59 0.00 0.00 0.00 0.00 54.91 54.31 1mgs h ALA 36 Cb 1.19 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 1mgs h ALA 36 CO 0.13 -0.57 0.00 -0.65 0.00 0.00 0.00 179.25 178.17 1mgs s GLN 37 N -4.94 4.24 0.67 0.00 1.11 -1.26 -4.58 119.66 114.89 1mgs s GLN 37 Ca -0.05 0.52 -0.17 0.00 0.01 0.00 0.00 55.36 55.67 1mgs s GLN 37 Cb 0.19 -3.54 -0.09 0.00 -1.01 0.00 0.00 33.01 28.56 1mgs s GLN 37 CO 0.69 -0.11 0.19 2.41 0.01 0.00 0.00 175.29 178.48 1mgs n THR 38 N 4.39 1.17 -4.02 -0.19 -1.04 -1.26 -4.51 114.28 108.82 1mgs n THR 38 Ca -0.04 -0.46 -0.26 0.00 -2.04 0.00 0.00 64.05 61.25 1mgs n THR 38 Cb 0.50 -0.44 -0.17 0.00 -1.82 0.00 0.00 70.33 68.41 1mgs n THR 38 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1mgs s GLU 39 N -2.06 1.57 0.09 -2.82 2.02 -1.06 -4.84 118.70 111.60 1mgs s GLU 39 Ca 0.61 -0.29 0.05 0.00 0.02 0.00 0.00 54.97 55.36 1mgs s GLU 39 Cb -0.39 -1.57 -0.04 0.00 0.10 0.00 0.00 34.13 32.23 1mgs s GLU 39 CO 0.62 -0.22 0.02 0.08 0.02 0.00 0.00 175.26 175.78 1mgs s VAL 40 N 1.53 4.12 -0.03 2.63 1.01 -1.24 -1.33 120.40 127.08 1mgs s VAL 40 Ca 0.02 -0.97 -0.04 0.00 0.00 0.00 0.00 61.98 60.99 1mgs s VAL 40 Cb -0.13 -2.98 0.01 0.00 0.00 0.00 0.00 36.38 33.28 1mgs s VAL 40 CO -0.06 0.10 0.10 -0.63 0.00 0.00 0.00 175.10 174.61 1mgs s ILE 41 N -1.36 0.03 -0.09 2.22 1.01 0.27 -2.31 121.20 120.97 1mgs s ILE 41 Ca 0.27 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.68 1mgs s ILE 41 Cb -0.12 -0.23 0.02 0.00 0.01 0.00 0.00 42.46 42.14 1mgs s ILE 41 CO 0.19 -0.13 -0.07 0.00 0.00 0.00 0.00 174.94 174.93 1mgs s ALA 42 N -0.40 1.13 -0.58 9.38 0.00 -0.80 -0.44 121.76 130.05 1mgs s ALA 42 Ca -0.05 -0.39 -0.22 0.00 0.00 0.00 0.00 51.96 51.30 1mgs s ALA 42 Cb -0.03 -0.76 0.06 0.00 0.00 0.00 0.00 23.12 22.39 1mgs s ALA 42 CO 0.00 -0.28 0.86 0.99 0.00 0.00 0.00 175.76 177.34 1mgs s THR 43 N 1.46 4.51 1.01 0.00 2.01 -0.97 -0.94 115.64 122.73 1mgs s THR 43 Ca -0.01 -0.22 -0.22 0.00 0.31 0.00 0.00 61.69 61.56 1mgs s THR 43 Cb -0.13 -4.53 -0.13 0.00 0.01 0.00 0.00 72.50 67.72 1mgs s THR 43 CO -0.05 -1.16 -0.95 0.18 -0.69 0.00 0.00 174.62 171.96 1mgs n LEU 44 N 7.16 -3.77 -0.83 4.42 4.77 0.25 0.16 117.00 129.16 1mgs n LEU 44 Ca -0.03 0.08 0.03 0.00 -0.03 0.00 0.00 56.01 56.06 1mgs n LEU 44 Cb 0.46 -0.71 0.14 0.00 -2.33 0.00 0.00 43.42 40.98 1mgs n LEU 44 CO 0.61 -3.93 0.52 2.29 -1.33 0.00 0.00 177.39 175.55 1mgs n LYS 45 N 1.60 2.15 -0.03 3.23 2.85 -1.13 -3.40 118.16 123.43 1mgs n LYS 45 Ca -0.01 -1.09 0.02 0.00 -1.05 0.00 0.00 58.31 56.17 1mgs n LYS 45 Cb 0.65 -1.58 0.03 0.00 -0.65 0.00 0.00 35.03 33.49 1mgs n LYS 45 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1mgs n ASN 46 N 0.25 1.88 0.00 -5.58 6.94 -1.26 -4.95 115.26 112.54 1mgs n ASN 46 Ca 0.10 -1.66 0.00 0.00 -0.02 0.00 0.00 54.58 53.00 1mgs n ASN 46 Cb 0.47 -0.04 0.00 0.00 -2.36 0.00 0.00 39.78 37.85 1mgs n ASN 46 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1mgs n GLY 47 N -0.05 0.90 3.84 4.83 0.00 -1.22 -5.08 105.19 108.41 1mgs n GLY 47 Ca 0.03 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1mgs n GLY 47 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mgs s ARG 48 N -0.61 2.29 0.06 1.61 0.52 -1.26 -4.94 118.95 116.62 1mgs s ARG 48 Ca 0.00 -1.90 0.00 0.00 -0.52 0.00 0.00 55.73 53.31 1mgs s ARG 48 Cb 0.00 -2.07 -0.03 0.00 0.52 0.00 0.00 34.95 33.36 1mgs s ARG 48 CO 0.00 -0.36 -0.05 0.15 0.02 0.00 0.00 175.30 175.06 1mgs s LYS 49 N -4.10 0.60 -0.17 3.54 1.02 -1.26 0.85 119.74 120.21 1mgs s LYS 49 Ca 0.37 -1.07 -0.06 0.00 0.02 0.00 0.00 55.97 55.22 1mgs s LYS 49 Cb -0.00 0.00 0.08 0.00 -0.52 0.00 0.00 37.83 37.39 1mgs s LYS 49 CO 0.21 -0.05 0.36 0.00 -0.92 0.00 0.00 175.35 174.96 1mgs s ALA 50 N -3.01 -0.94 0.26 5.17 0.00 -0.11 -4.85 121.76 118.27 1mgs s ALA 50 Ca 0.02 1.30 -0.29 0.00 0.00 0.00 0.00 51.96 52.98 1mgs s ALA 50 Cb 0.01 -1.20 -0.09 0.00 0.00 0.00 0.00 23.12 21.84 1mgs s ALA 50 CO -0.05 -0.69 0.96 0.00 0.00 0.00 0.00 175.76 175.97 1mgs s LEU 52 N -1.33 2.50 -0.19 0.00 1.43 -0.98 -0.51 118.68 119.60 1mgs s LEU 52 Ca 0.43 -1.34 -0.06 0.00 -1.03 0.00 0.00 54.13 52.12 1mgs s LEU 52 Cb -0.26 -0.63 -0.03 0.00 0.03 0.00 0.00 46.19 45.30 1mgs s LEU 52 CO 0.32 -0.49 0.04 0.21 0.23 0.00 0.00 176.35 176.66 1mgs s ASN 53 N -3.56 5.30 0.00 2.29 2.47 -0.97 -3.73 114.94 116.74 1mgs s ASN 53 Ca 0.35 -0.04 0.20 0.00 0.42 0.00 0.00 52.86 53.78 1mgs s ASN 53 Cb 0.08 -1.91 1.17 0.00 -1.45 0.00 0.00 41.25 39.14 1mgs s ASN 53 CO 0.16 0.12 1.62 -0.81 -3.72 0.00 0.00 177.10 174.47 1mgs n PRO 54 N 3.89 0.79 0.14 0.43 -0.04 -1.26 -2.78 135.00 136.17 1mgs n PRO 54 Ca -0.17 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.41 1mgs n PRO 54 Cb 0.52 -1.39 0.10 0.00 -0.04 0.00 0.00 33.50 32.69 1mgs n PRO 54 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mgs h ALA 55 N 3.35 0.70 -2.20 0.55 0.00 -1.97 -3.43 119.26 116.25 1mgs h ALA 55 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.44 1mgs h ALA 55 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.82 1mgs h ALA 55 CO 0.00 0.00 0.01 -1.54 0.00 0.00 0.00 179.25 177.72 1mgs s SER 56 N -5.44 5.96 0.13 0.00 1.04 -1.12 -5.01 113.70 109.27 1mgs s SER 56 Ca 0.03 0.58 0.01 0.00 0.48 0.00 0.00 55.95 57.05 1mgs s SER 56 Cb 0.09 -1.83 -0.12 0.00 0.10 0.00 0.00 66.02 64.25 1mgs s SER 56 CO 0.73 -0.69 1.30 1.55 0.98 0.00 0.00 173.24 177.10 1mgs h PRO 57 N 0.27 0.19 -0.33 4.02 0.13 -1.89 -3.10 132.00 131.29 1mgs h PRO 57 Ca -0.47 -0.25 -0.17 0.00 -0.87 0.00 0.00 66.00 64.24 1mgs h PRO 57 Cb 1.24 0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 1mgs h PRO 57 CO 0.60 1.04 -0.46 0.97 -0.23 0.00 0.00 178.00 179.92 1mgs h ILE 58 N 0.09 1.27 -0.16 -3.56 2.10 -1.92 -1.95 117.51 113.37 1mgs h ILE 58 Ca -0.06 -1.63 -0.00 0.00 1.08 0.00 0.00 64.86 64.24 1mgs h ILE 58 Cb 1.68 1.52 -0.01 0.00 -1.09 0.00 0.00 36.82 38.92 1mgs h ILE 58 CO 0.15 0.54 0.08 0.58 -1.08 0.00 0.00 178.15 178.43 1mgs h VAL 59 N 0.69 1.11 0.00 2.19 2.07 -1.69 0.38 116.25 121.01 1mgs h VAL 59 Ca 0.04 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1mgs h VAL 59 Cb 1.06 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1mgs h VAL 59 CO 0.11 0.10 -0.04 0.11 0.02 0.00 0.00 177.57 177.87 1mgs h LYS 60 N 0.15 0.00 0.00 1.57 1.57 -1.51 0.88 116.57 119.22 1mgs h LYS 60 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1mgs h LYS 60 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1mgs h LYS 60 CO -0.01 0.04 -0.19 0.87 -0.57 0.00 0.00 179.45 179.60 1mgs h LYS 61 N 0.00 0.00 -0.18 3.15 1.79 -0.44 -2.66 116.57 118.23 1mgs h LYS 61 Ca -0.00 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.27 1mgs h LYS 61 Cb 0.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1mgs h LYS 61 CO 0.01 0.00 -0.70 0.82 -1.08 0.00 0.00 179.45 178.50 1mgs h ILE 62 N 0.00 1.29 0.20 1.86 2.04 0.22 -1.08 117.51 122.05 1mgs h ILE 62 Ca 0.00 -1.92 -0.01 0.00 1.00 0.00 0.00 64.86 63.93 1mgs h ILE 62 Cb 0.98 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.96 1mgs h ILE 62 CO 0.00 0.61 -0.09 0.40 0.00 0.00 0.00 178.15 179.06 1mgs h ILE 63 N 0.53 0.00 -0.71 -0.67 5.03 -1.46 -2.77 117.51 117.46 1mgs h ILE 63 Ca -0.03 -0.62 0.16 0.00 -0.12 0.00 0.00 64.86 64.25 1mgs h ILE 63 Cb 1.30 0.00 -0.12 0.00 -3.03 0.00 0.00 36.82 34.97 1mgs h ILE 63 CO 0.14 0.00 0.00 -0.08 -0.68 0.00 0.00 178.15 177.54 1mgs h GLU 64 N -0.89 0.11 0.05 2.37 4.22 -1.59 -0.37 114.58 118.47 1mgs h GLU 64 Ca -0.03 -0.01 0.03 0.00 0.08 0.00 0.00 59.36 59.43 1mgs h GLU 64 Cb 0.20 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.38 1mgs h GLU 64 CO 0.04 0.07 -0.41 -0.22 -2.18 0.00 0.00 179.01 176.31 1mgs h LYS 65 N 0.11 -0.58 -0.82 1.92 1.63 -1.28 -0.89 116.57 116.66 1mgs h LYS 65 Ca 0.38 0.04 0.18 0.00 -0.85 0.00 0.00 60.65 60.41 1mgs h LYS 65 Cb 0.66 0.13 -0.15 0.00 -0.60 0.00 0.00 32.23 32.27 1mgs h LYS 65 CO -0.62 -0.39 -0.08 1.98 -3.45 0.00 0.00 179.45 176.89 1mgs h MET 66 N -0.60 0.04 -0.35 1.90 4.05 -0.78 0.18 114.93 119.38 1mgs h MET 66 Ca 0.04 -0.00 0.07 0.00 -0.28 0.00 0.00 59.70 59.53 1mgs h MET 66 Cb 0.66 -0.01 -0.09 0.00 -0.80 0.00 0.00 31.60 31.36 1mgs h MET 66 CO -0.29 0.03 -0.33 -0.07 0.23 0.00 0.00 176.91 176.49 1mgs h LEU 67 N 0.05 -1.08 -1.72 3.39 3.38 -0.54 0.37 115.31 119.15 1mgs h LEU 67 Ca 0.43 0.18 0.11 0.00 0.09 0.00 0.00 57.88 58.69 1mgs h LEU 67 Cb 0.75 0.50 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 1mgs h LEU 67 CO -0.78 -0.33 0.38 -1.13 0.09 0.00 0.00 178.44 176.68 1mgs h ASN 68 N -0.28 0.28 -0.62 -0.43 -1.24 -0.25 -2.57 115.58 110.46 1mgs h ASN 68 Ca 0.16 0.01 0.07 0.00 0.71 0.00 0.00 56.30 57.24 1mgs h ASN 68 Cb 0.54 -0.05 -0.10 0.00 0.73 0.00 0.00 38.32 39.44 1mgs h ASN 68 CO -0.51 0.17 -0.55 0.77 -1.29 0.00 0.00 177.43 176.02 1mgs h SER 69 N 0.31 -1.90 0.00 1.15 4.64 0.71 -3.44 113.55 115.03 1mgs h SER 69 Ca 0.26 0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 1mgs h SER 69 Cb 0.62 0.81 0.00 0.00 -0.31 0.00 0.00 62.40 63.52 1mgs h SER 69 CO -0.06 -0.34 0.00 -0.67 -0.87 0.00 0.00 176.83 174.89 1mgs n ASP 70 N -5.35 0.00 0.00 4.97 2.03 -0.97 -3.79 116.55 113.45 1mgs n ASP 70 Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1mgs n ASP 70 Cb 0.32 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.72 1mgs n ASP 70 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1mgs n LYS 71 N 0.00 0.00 -3.79 -0.67 5.02 -1.26 -5.12 118.16 112.34 1mgs n LYS 71 Ca 0.00 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 1mgs n LYS 71 Cb 0.00 -0.04 -0.09 0.00 -0.02 0.00 0.00 35.03 34.88 1mgs n LYS 71 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1mgs s SER 72 N -2.27 -0.15 0.00 4.39 1.04 -1.25 -5.28 113.70 110.18 1mgs s SER 72 Ca 0.00 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.51 1mgs s SER 72 Cb 0.00 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1mgs s SER 72 CO 0.00 -0.38 0.12 -0.46 0.98 0.00 0.00 173.24 173.50